methyl 3-[4-(morpholine-4-carbonyl)phenyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[4-(morpholine-4-carbonyl)phenyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-[4-(morpholine-4-carbonyl)phenyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | F207-0350 |
| Compound Name: | methyl 3-[4-(morpholine-4-carbonyl)phenyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 425.46 |
| Molecular Formula: | C21 H19 N3 O5 S |
| Smiles: | COC(c1ccc2C(N(C(Nc2c1)=S)c1ccc(cc1)C(N1CCOCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7116 |
| logD: | 1.6903 |
| logSw: | -2.6838 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.437 |
| InChI Key: | WRCJPEXGLPPOMG-UHFFFAOYSA-N |